[(1R)-1-(4-methoxyphenyl)-2-(7H-purin-6-ylamino)ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-1-(4-methoxyphenyl)-2-(7H-purin-6-ylamino)ethyl]-dimethyl-azanium Openeye Name: [(1R)-1-(4-methoxyphenyl)-2-(7H-purin-6-ylamino)ethyl]-dimethyl-ammonium CAS Name: [(1R)-1-(4-methoxyphenyl)-2-(7H-purin-6-ylamino)ethyl]-dimethylammonium IUPAC Name: [(1R)-1-(4-methoxyphenyl)-2-(7H-purin-6-ylamino)ethyl]-dimethylazanium Traditional Name: [(1R)-1-(4-methoxyphenyl)-2-(7H-purin-6-ylamino)ethyl]-dimethyl-ammonium Formula: C16H21N6O+ MolecularWeight: 313.37754

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC1=NC=NC2=C1NC=N2)C3=CC=C(C=C3)OC

Isomeric SMILES

C[NH+](C)[C@@H](CNC1=NC=NC2=C1NC=N2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C16H20N6O/c1-22(2)13(11-4-6-12(23-3)7-5-11)8-17-15-14-16(19-9-18-14)21-10-20-15/h4-7,9-10,13H,8H2,1-3H3,(H2,17,18,19,20,21)/p+1/t13-/m0/s1